N-(4-bromo-2-fluorophenyl)-2-{[5-(3-chloro-4-methoxybenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-2-{[5-(3-chloro-4-methoxybenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
N-(4-bromo-2-fluorophenyl)-2-{[5-(3-chloro-4-methoxybenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | C200-5330 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-2-{[5-(3-chloro-4-methoxybenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 562.82 |
| Molecular Formula: | C19 H14 Br Cl F N3 O5 S2 |
| Smiles: | COc1ccc(cc1[Cl])S(C1=CN=C(NC1=O)SCC(Nc1ccc(cc1F)[Br])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8396 |
| logD: | 1.1979 |
| logSw: | -3.5484 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.073 |
| InChI Key: | XDQIMIRMLUZMOI-UHFFFAOYSA-N |